Charge: 2
Inchi:1S/C10H9/c1-2-5-9-7-4-8-10(9)6-3-1/h1-7H,8H2/q+2
Electronic States
Energy
(eV)
-385.33849
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09497 b
(cm-1)
0.04175 c
(cm-1)
0.02900
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.45804
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.95600
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.04156
2
0.00000
-0.03855
0.03042
3
0.00000
0.03855
0.03042
4
0.00000
0.01638
-0.00496
5
0.00000
-0.01638
-0.00496
6
0.00000
0.00008
-0.00101
7
0.00000
-0.00008
-0.00101
8
0.00000
0.00074
0.00037
9
0.00000
-0.00074
0.00037
10
0.00000
0.00000
0.00019
11
0.00000
0.00000
-0.46192
12
0.00000
-0.43288
-0.35241
13
0.00000
0.43288
-0.35241
14
0.00000
-0.18336
0.04077
15
0.00000
0.18336
0.04077
16
0.00000
-0.00797
-0.00190
17
0.00000
0.00797
-0.00190
18
0.00000
0.00000
0.00060